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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg10-Jul-2017Keggin-M_diss-H4SiMo12O40Rellán, Marcosvasp; 5.3.3; 18Dez12 (build Apr 2 2013 15:16:02) gamma-onlyGeometry optimization---550.53083802; eV
thumbnail.jpeg10-Jul-2017Mannose_without_-O4HRellán, Marcosvasp; 5.3.3; 18Dez12 (build Apr 2 2013 15:16:02) gamma-onlyGeometry optimization---131.82796329; eV
thumbnail.jpeg10-Jul-2017MoO3-TS_dissRellán, Marcosvasp; 5.3.3; 18Dez12 (build Jan 17 2013 15:17:09) complexImproved Dimer Method---1220.74620377; eV
thumbnail.jpeg10-Jul-2017Keggin-TS_epim-H4GeMo12O40Rellán, Marcosvasp; 5.3.3; 18Dez12 (build Apr 2 2013 15:16:02) gamma-onlyGeometry optimization---545.09498260; eV
thumbnail.jpeg10-Jul-2017Keggin-G_diss-H4GeMo12O40Rellán, Marcosvasp; 5.3.3; 18Dez12 (build Apr 2 2013 15:16:02) gamma-onlyGeometry optimization---546.19134510; eV
thumbnail.jpeg10-Jul-2017Keggin-M_diss(no-O4H)Rellán, Marcosvasp; 5.3.3; 18Dez12 (build Apr 2 2013 15:16:02) gamma-onlyGeometry optimization---539.53194678; eV
thumbnail.jpeg10-Jul-2017Keggin-TS_epim(no-O4H)Rellán, Marcosvasp; 5.3.3; 18Dez12 (build Apr 2 2013 15:16:02) gamma-onlyGeometry optimization---538.51914430; eV
thumbnail.jpeg10-Jul-2017Keggin-TS_epim(no-O3H)Rellán, Marcosvasp; 5.3.3; 18Dez12 (build Apr 2 2013 15:16:02) gamma-onlyGeometry optimization---538.34522901; eV
thumbnail.jpeg10-Jul-2017H6P2Mo18O62-OtHRellán, Marcosvasp; 5.3.3; 18Dez12 (build Apr 2 2013 15:16:02) gamma-onlyGeometry optimization---639.76703054; eV
thumbnail.jpeg10-Jul-2017Dawsson-TS_epimRellán, Marcosvasp; 5.3.3; 18Dez12 (build Apr 2 2013 15:16:02) gamma-onlyGeometry optimization---772.41761892; eV
Results 1-10 of 63 (Search time: 0.0 seconds).